Density functional theory calculations of the nuclear magnetic resonance spin-Hamiltonian parameters for two polyamines of prostate tissue: Spermidine and spermine

Measurement Science and Technology

Volumn 20, Issue 10, 2009, Pages

  Atieh, Z ^a,b,c   Allouche, A R ^a,b,c   Graveron Demilly, D ^a,b,c   Fauvelle, F ^d   Aubert Frecon M ^a,b,c  

^a UNIVERSITÉ DE LYON   (France)

^b UNIVERSITÉ LYON 1   (France)

^c CNRS   (France)

^d CENTRE DE RECHERCHES   (France)

Author keywords

DFT B3LYP calculations; NMR parameters; Simulated and calculated NMR spectra; Spermidine; Spermine

Indexed keywords

AMINES; DENSITY FUNCTIONAL THEORY; HAMILTONIANS; MOLECULES; NUCLEAR MAGNETIC RESONANCE SPECTROSCOPY; TISSUE; UROLOGY;

DFT/B3LYP CALCULATIONS; NMR SPECTRUM; NUCLEAR MAGNETIC RESONANCE(NMR); PROSTATE TISSUE; SPERMIDINE; SPERMINE; SPIN HAMILTONIAN PARAMETERS; SPIN-SPIN COUPLING CONSTANTS;

NUCLEAR MAGNETIC RESONANCE;

EID: 84961978383     PISSN: 09570233     EISSN: 13616501     Source Type: Journal    
DOI: 10.1088/0957-0233/20/10/104024     Document Type: Article

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